N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide

C18H24N2O2 — CID 113212089

IUPACN-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide
SMILESCOc1ccc2[nH]c(C)c(CC(=O)NC3CCCCC3)c2c1
InChIInChI=1S/C18H24N2O2/c1-12-15(11-18(21)20-13-6-4-3-5-7-13)16-10-14(22-2)8-9-17(16)19-12/h8-10,13,19H,3-7,11H2,1-2H3,(H,20,21)
InChIKeyYOSKIFYTLWNNEM-UHFFFAOYSA-N
MW300.40 g/mol
LogP3.48
Rot. Bonds4

About N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide

N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide (PubChem CID 113212089) has the molecular formula C18H24N2O2 and a molecular weight of 300.40 g/mol. Its IUPAC name is N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide
PubChem CID113212089
Molecular FormulaC18H24N2O2
Molecular Weight300.40 g/mol
Exact Mass300.18
IUPAC NameN-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide
SMILESCOc1ccc2[nH]c(C)c(CC(=O)NC3CCCCC3)c2c1
InChIInChI=1S/C18H24N2O2/c1-12-15(11-18(21)20-13-6-4-3-5-7-13)16-10-14(22-2)8-9-17(16)19-12/h8-10,13,19H,3-7,11H2,1-2H3,(H,20,21)
InChIKeyYOSKIFYTLWNNEM-UHFFFAOYSA-N
XLogP3.48
TPSA54.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500300.40
LogP ≤ 53.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Related Compounds

2-(5-bromo-2-methyl-1H-indol-3-yl)-N-cycloheptylacetamide
CID 38702160
2-(5-methoxy-2-methyl-1H-indol-3-yl)-N-(3-methoxyphenyl)acetamide
CID 113212201
N-(2,5-dimethoxyphenyl)-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide
CID 113212208
2-(5-methoxy-2-methyl-1H-indol-3-yl)-N-[[(4R)-4-prop-1-en-2-ylcyclohexen-1-yl]methyl]acetamide
CID 11035569
N-(2,4-dimethylphenyl)-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide
CID 113212169
N-cycloheptyl-2-(2,5-dimethoxyphenyl)acetamide
CID 7580886
N-[2-(5-methoxy-2-methyl-1H-indol-3-yl)ethyl]cyclobutanecarboxamide
CID 113086137
N-(3,4-dichlorophenyl)-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide
CID 113212248
N-(1,3-benzodioxol-5-yl)-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide
CID 113212238
2-(5-fluoro-2-methyl-1H-indol-3-yl)-N-(3-methylcyclohexyl)acetamide
CID 134005288
1-(4-acetylpiperazin-1-yl)-2-(5-methoxy-2-methyl-1H-indol-3-yl)ethanone
CID 113212099
methyl 3-[[2-(5-methoxy-2-methyl-1H-indol-3-yl)acetyl]amino]benzoate
CID 113212219

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide?
The IUPAC name of N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide (CID 113212089) is N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide.
What is the SMILES notation for N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide?
The canonical SMILES for N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide is COc1ccc2[nH]c(C)c(CC(=O)NC3CCCCC3)c2c1.
What is the InChIKey of N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide?
The InChIKey is YOSKIFYTLWNNEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O2/c1-12-15(11-18(21)20-13-6-4-3-5-7-13)16-10-14(22-2)8-9-17(16)19-12/h8-10,13,19H,3-7,11H2,1-2H3,(H,20,21).
What are the key properties of N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide?
N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide has a molecular weight of 300.40 g/mol, XLogP of 3.48, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(5-methoxy-2-methyl-1H-indol-3-yl)acetamide is sourced from PubChem (CID 113212089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).